| SpectraBase Compound ID | wrAGlNCf3T |
|---|---|
| InChI | InChI=1S/C13H20O4/c1-4-6-7-10-16-12(14)8-9-13(15)17-11(3)5-2/h2,11H,4,6-10H2,1,3H3 |
| InChIKey | KFRIAKZIOLLKGQ-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C13H20O4 |
| Exact Mass | 240.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KSaigslA4La |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.136159120 u |
| Formula | C13H20O4 |
| InChI | InChI=1S/C13H20O4/c1-4-6-7-10-16-12(14)8-9-13(15)17-11(3)5-2/h2,11H,4,6-10H2,1,3H3 |
| InChIKey | KFRIAKZIOLLKGQ-UHFFFAOYSA-N |
| Molecular Weight | 240.299 g/mol |
| SMILES | C(CCC(OC(C#C)C)=O)(OCCCCC)=O |